2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(E)-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-[(E)-3-(2,4-dichlorophenyl)acryloyl]piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C18H24Cl2N3O2+ MolecularWeight: 385.30806

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)C=CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H23Cl2N3O2/c1-2-7-21-17(24)13-22-8-10-23(11-9-22)18(25)6-4-14-3-5-15(19)12-16(14)20/h3-6,12H,2,7-11,13H2,1H3,(H,21,24)/p+1/b6-4+